(Z,2R)-N-[(2S,3S,4R)-1-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-16-methyl-3,4-bis(oxidanyl)heptadecan-2-yl]-2-oxidanyl-octacos-21-enamide

Systemtic Name: (Z,2R)-N-[(2S,3S,4R)-1-[(2R,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-16-methyl-3,4-bis(oxidanyl)heptadecan-2-yl]-2-oxidanyl-octacos-21-enamide Openeye Name: (Z,2R)-N-[(1S,2S,3R)-2,3-dihydroxy-15-methyl-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]hexadecyl]-2-hydroxy-octacos-21-enamide CAS Name: (Z,2R)-N-[(2S,3S,4R)-3,4-dihydroxy-16-methyl-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]heptadecan-2-yl]-2-hydroxy-21-octacosenamide IUPAC Name: (Z,2R)-N-[(2S,3S,4R)-3,4-dihydroxy-16-methyl-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyheptadecan-2-yl]-2-hydroxyoctacos-21-enamide Traditional Name: (Z,2R)-N-[(1S,2S,3R)-2,3-dihydroxy-15-methyl-1-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxymethyl]hexadecyl]-2-hydroxy-octacos-21-enamide Formula: C52H101NO10 MolecularWeight: 900.35904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CCCCCCCCCCCCCCCCCCCC(C(=O)NC(COC1C(C(C(C(O1)CO)O)O)O)C(C(CCCCCCCCCCCC(C)C)O)O)O

Isomeric SMILES

CCCCCC/C=C\CCCCCCCCCCCCCCCCCC[C@H](C(=O)N[C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)[C@@H]([C@@H](CCCCCCCCCCCC(C)C)O)O)O

InChI

InChI=1S/C52H101NO10/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-30-33-36-39-45(56)51(61)53-43(41-62-52-50(60)49(59)48(58)46(40-54)63-52)47(57)44(55)38-35-32-29-27-24-25-28-31-34-37-42(2)3/h9-10,42-50,52,54-60H,4-8,11-41H2,1-3H3,(H,53,61)/b10-9-/t43-,44+,45+,46+,47-,48+,49-,50+,52+/m0/s1